Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C38H46F4N6O9S.H2O |
| Molecular Weight | 856.881 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[H][C@@]12C[C@H](N(C1)C(=O)[C@@H](NC(=O)O[C@]3([H])CCC[C@@]3([H])OC\C=C\C(F)(F)C4=NC5=CC=CC=C5N=C4O2)C(C)(C)C)C(=O)N[C@@]6(C[C@H]6C(F)F)C(=O)NS(=O)(=O)C7(C)CC7
InChI
InChIKey=URRDETDWTZIRAA-UKBVCNFKSA-N
InChI=1S/C38H46F4N6O9S.H2O/c1-35(2,3)28-32(50)48-19-20(17-24(48)30(49)46-37(18-21(37)29(39)40)33(51)47-58(53,54)36(4)14-15-36)56-31-27(43-22-9-5-6-10-23(22)44-31)38(41,42)13-8-16-55-25-11-7-12-26(25)57-34(52)45-28;/h5-6,8-10,13,20-21,24-26,28-29H,7,11-12,14-19H2,1-4H3,(H,45,52)(H,46,49)(H,47,51);1H2/b13-8+;/t20-,21+,24+,25-,26-,28-,37-;/m1./s1
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C38H46F4N6O9S |
| Molecular Weight | 838.865 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:06:15 UTC 2023
by
admin
on
Sat Dec 16 19:06:15 UTC 2023
|
| Record UNII |
2QC49GD4S6
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Common Name | English | ||
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Systematic Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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134694621
Created by
admin on Sat Dec 16 19:06:15 UTC 2023 , Edited by admin on Sat Dec 16 19:06:15 UTC 2023
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PRIMARY | |||
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300000015121
Created by
admin on Sat Dec 16 19:06:15 UTC 2023 , Edited by admin on Sat Dec 16 19:06:15 UTC 2023
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PRIMARY | |||
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2QC49GD4S6
Created by
admin on Sat Dec 16 19:06:15 UTC 2023 , Edited by admin on Sat Dec 16 19:06:15 UTC 2023
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PRIMARY | |||
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1838572-01-2
Created by
admin on Sat Dec 16 19:06:15 UTC 2023 , Edited by admin on Sat Dec 16 19:06:15 UTC 2023
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NON-SPECIFIC STOICHIOMETRY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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ANHYDROUS->SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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